MCULE-8195633162
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
![]() Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
![]() Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
---|---|---|---|---|
1 mg | 90 USD | 95 | 20 working days | Get Quote |
5 mg | 90 USD | 95 | 20 working days | Get Quote |
10 mg | 90 USD | 95 | 20 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
Name | File |
---|---|
SDF | MCULE-8195633162.sdf |
SMILES | MCULE-8195633162.smiles |
Standard InChI | MCULE-8195633162.inchi |
InChIKey | MCULE-8195633162.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886628465 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
P-889934129 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-869369416 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893600293 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.65 g |
P-606878222 | AmBeed | In stock | N/A | As is | in stock |
P-875890906 | Angene | Building Blocks in stock | 95 | As is | 750 mg |
P-889781220 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-873438626 | BLD pharm | In-stock building blocks | 95 | As is | 750 mg |
P-868649980 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
P-580427513 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-889311370 | FluoroChem | General BB | N/A | As is | in stock |
P-502486721 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-855939822 | Key Organics | Building Blocks | 95 | As is | 250 mg |
P-579645568 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
P-31253707 | LaboTest | Screening Collection | 90 | As is | 500 mg |
P-854832966 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-856065095 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 500 mg |
P-611601574 | Toronto Research | In stock | 90 | As is | in stock |
P-894003932 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 213.231 |
logP | 2.7552 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 2 |
PSA | 50.19 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 61.5983 |
Atoms | 27 |
Rings | 2 |
Heavy atoms | 16 |
Hydrogen atoms | 11 |
Heteroatoms | 3 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 0 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |